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3-(2,4,5-Trimethoxyphenyl)propanal
SpectraBase Compound ID CnmDjRFtNjr
InChI InChI=1S/C12H16O4/c1-14-10-8-12(16-3)11(15-2)7-9(10)5-4-6-13/h6-8H,4-5H2,1-3H3
InChIKey XJLCKKVBWNWFDQ-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATjTqyyhTXN
Name 3-(2,4,5-Trimethoxyphenyl)propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-14-10-8-12(16-3)11(15-2)7-9(10)5-4-6-13/h6-8H,4-5H2,1-3H3
InChIKey XJLCKKVBWNWFDQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol400818v
Molecular Weight 224.256 g/mol
SMILES c1(cc(CCC=O)c(OC)cc1OC)OC
SPLASH splash10-0089-0930000000-bd064e8e101f19f40a53
Source of Spectrum A1-15-2330/SM12-3ba
Synonyms 3-Asarylpropionaldehyde
Wiley ID 1748620